Chemical Properties of 1-(2-Chloroethyldithio)-4-(2-chloroethylthio)butane

InChI

InChI=1S/C8H16Cl2S3/c9-3-7-11-5-1-2-6-12-13-8-4-10/h1-8H2

InChI Key

HKUHXMSHILQITM-UHFFFAOYSA-N

Formula

C8H16Cl2S3

SMILES

ClCCSCCCCSSCCCl

Molecular Weight¹

279.31

Other Names

• 1-(2-Chloroethylthio)-4-(2-chloroethyldithio)butane

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	91.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-114.32	kJ/mol	Joback Calculated Property
ΔfusH°	37.26	kJ/mol	Joback Calculated Property
ΔvapH°	62.62	kJ/mol	Joback Calculated Property
log10WS	-4.12		Crippen Calculated Property
logPoct/wat	4.359		Crippen Calculated Property
McVol	197.110	ml/mol	McGowan Calculated Property
Pc	2477.65	kPa	Joback Calculated Property
Inp	[1933.00; 1933.00]
Inp	1933.00		NIST
Inp	1933.00		NIST
Inp	1933.00		NIST
Tboil	663.64	K	Joback Calculated Property
Tc	895.12	K	Joback Calculated Property
Tfus	342.96	K	Joback Calculated Property
Vc	0.744	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[444.51; 509.08]	J/mol×K	[663.64; 895.12]
Cp,gas	444.51	J/mol×K	663.64	Joback Calculated Property
Cp,gas	457.42	J/mol×K	702.22	Joback Calculated Property
Cp,gas	469.46	J/mol×K	740.80	Joback Calculated Property
Cp,gas	480.64	J/mol×K	779.38	Joback Calculated Property
Cp,gas	490.96	J/mol×K	817.96	Joback Calculated Property
Cp,gas	500.44	J/mol×K	856.54	Joback Calculated Property
Cp,gas	509.08	J/mol×K	895.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-(2-Chloroethyldithio)-4-(2-chloroethylthio)butane.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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